1-(4-nitrophenyl)-3-(1,4,7,10-tetraazacyclododecan-1-yl)propan-2-amine hydrochloride

Base Information

• Chemical Name: 1-(4-nitrophenyl)-3-(1,4,7,10-tetraazacyclododecan-1-yl)propan-2-amine hydrochloride
• CAS No.: 1352042-12-6
• Molecular Formula: C₁₇H₃₀N₆O₂*ClH
• Molecular Weight: 386.925
• Mol file: 1352042-12-6.mol

Synonyms:1-(4-nitrophenyl)-3-(1,4,7,10-tetraazacyclododecan-1-yl)propan-2-amine hydrochloride

Chemical Property of 1-(4-nitrophenyl)-3-(1,4,7,10-tetraazacyclododecan-1-yl)propan-2-amine hydrochloride

Chemical Property:

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

Technology Process of 1-(4-nitrophenyl)-3-(1,4,7,10-tetraazacyclododecan-1-yl)propan-2-amine hydrochloride

There total 3 articles about 1-(4-nitrophenyl)-3-(1,4,7,10-tetraazacyclododecan-1-yl)propan-2-amine hydrochloride which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 99.0%

tert-butyl N-[1-(4-nitrophenyl)-3-(1,4,7,10-tetraazacyclododecan-1-yl)propan-2-yl]carbamate (1258945-84-4) → 1-(4-nitrophenyl)-3-(1,4,7,10-tetraazacyclododecan-1-yl)propan-2-amine hydrochloride (1352042-12-6)

Guidance literature:

With hydrogenchloride; In 1,4-dioxane; at 20 ℃; for 14h; Cooling with ice;

DOI:10.1016/j.bmcl.2011.06.107

Reference yield:

tert-butyl 2-(4-nitrobenzyl)aziridine 1-carboxylate (1005484-23-0) → 1-(4-nitrophenyl)-3-(1,4,7,10-tetraazacyclododecan-1-yl)propan-2-amine hydrochloride (1352042-12-6)

Guidance literature:

Multi-step reaction with 2 steps

1: acetonitrile

2: hydrogenchloride / 1,4-dioxane / 14 h / 20 °C / Cooling with ice

With hydrogenchloride; In 1,4-dioxane; acetonitrile;

DOI:10.1016/j.bmcl.2011.06.107

Reference yield:

1,4,7,10-tetraazacyclododecan (294-90-6) → 1-(4-nitrophenyl)-3-(1,4,7,10-tetraazacyclododecan-1-yl)propan-2-amine hydrochloride (1352042-12-6)

Guidance literature:

Multi-step reaction with 2 steps

1: acetonitrile

2: hydrogenchloride / 1,4-dioxane / 14 h / 20 °C / Cooling with ice

With hydrogenchloride; In 1,4-dioxane; acetonitrile;

DOI:10.1016/j.bmcl.2011.06.107

upstream raw materials:

tert-butyl 2-(4-nitrobenzyl)aziridine 1-carboxylate

tert-butyl N-[1-(4-nitrophenyl)-3-(1,4,7,10-tetraazacyclododecan-1-yl)propan-2-yl]carbamate

1,4,7,10-tetraazacyclododecan

Downstream raw materials:

tert-butyl 2-{[2-(tert-butoxy)-2-oxoethyl]({1-[4-(nitro)phenyl]-3-{4,7,10-tris[2-(tert-butoxy)-2-oxoethyl]-1,4,7,10-tetraazacyclododecan-1-yl}propan-2-yl})amino}acetate

2-[(carboxymethyl)[1-(4-nitrophenyl)-3-[4,7,10-tris(carboxymethyl)-1,4,7,10-tetraazacyclododecan-1-yl]propan-2-yl]amino]acetic acid

2-[(carboxymethyl)[1-(4-isothiocyanatophenyl)-3-[4,7,10-tris(carboxymethyl)-1,4,7,10-tetraazacyclododecan-1-yl]propan-2-yl]amino]acetic acid

2-{[1-(4-aminophenyl)-3-[4,7,10-tris(carboxymethyl)-1,4,7,10-tetraazacyclododecan-1-yl]propan-2-yl](carboxymethyl)amino}acetic acid